ethyl 4-[1-azanyl-4-methyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)pent-3-en-2-yl]benzoate

Systemtic Name: ethyl 4-[1-azanyl-4-methyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)pent-3-en-2-yl]benzoate Openeye Name: ethyl 4-[1-carbamoyl-3-methyl-2-[2-(1-piperidyl)phenyl]but-2-enyl]benzoate CAS Name: 4-[1-amino-4-methyl-1-oxo-3-[2-(1-piperidinyl)phenyl]pent-3-en-2-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-amino-4-methyl-1-oxo-3-(2-piperidin-1-ylphenyl)pent-3-en-2-yl]benzoate Traditional Name: 4-[1-carbamoyl-3-methyl-2-(2-piperidinophenyl)but-2-enyl]benzoic acid ethyl ester Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(C(=C(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(C(=C(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)N

InChI

InChI=1S/C26H32N2O3/c1-4-31-26(30)20-14-12-19(13-15-20)24(25(27)29)23(18(2)3)21-10-6-7-11-22(21)28-16-8-5-9-17-28/h6-7,10-15,24H,4-5,8-9,16-17H2,1-3H3,(H2,27,29)